(2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol

C11H16N2O — CID 115096233

IUPAC(2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol
SMILESCC1(C)CNc2cc(CO)ccc2N1
InChIInChI=1S/C11H16N2O/c1-11(2)7-12-10-5-8(6-14)3-4-9(10)13-11/h3-5,12-14H,6-7H2,1-2H3
InChIKeyIJJRHHRTUIGTPI-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.79
Rot. Bonds1

About (2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol

(2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol (PubChem CID 115096233) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is (2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol.

Molecular Properties

Compound Name(2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol
PubChem CID115096233
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name(2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol
SMILESCC1(C)CNc2cc(CO)ccc2N1
InChIInChI=1S/C11H16N2O/c1-11(2)7-12-10-5-8(6-14)3-4-9(10)13-11/h3-5,12-14H,6-7H2,1-2H3
InChIKeyIJJRHHRTUIGTPI-UHFFFAOYSA-N
XLogP1.79
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2,2-dimethyl-3,4-dihydro-1H-quinolin-6-yl)methanol
CID 15720423
3,3-dimethyl-7-pyrrolidin-1-yl-2,4-dihydro-1H-quinoxaline
CID 96599386
[7-(hydroxymethyl)-2,2-dimethyl-3,4-dihydro-1H-quinolin-4-yl]methanesulfonic acid
CID 58350917
(3-methyl-1,2,3,4-tetrahydroquinoxalin-6-yl)methanol
CID 115096326
7-(hydroxymethyl)-1,3,3-trimethyl-4H-quinoxalin-2-one
CID 115096207
3,4-dihydro-2H-1,4-benzoxazin-6-ylmethanol
CID 12000271
(3,4-diaminophenyl)methanol;hydrochloride
CID 174554686
(3,4-diaminophenyl)methanol;dihydrochloride
CID 24721578
2-[2-(hydroxymethyl)-2-methyl-3-oxo-1,4-dihydroquinoxalin-6-yl]acetamide
CID 141209066
7-(hydroxymethyl)-3,3-dimethyl-1-propan-2-yl-4H-quinoxalin-2-one
CID 115096214
4-(2,2-dimethyl-3,4-dihydro-1,4-benzoxazin-6-yl)butan-1-amine
CID 82341416
3,5-diethyl-3-methyl-1,2-dihydroindole
CID 165441920

Frequently Asked Questions

What is the IUPAC name of (2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol?
The IUPAC name of (2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol (CID 115096233) is (2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol.
What is the SMILES notation for (2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol?
The canonical SMILES for (2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol is CC1(C)CNc2cc(CO)ccc2N1.
What is the InChIKey of (2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol?
The InChIKey is IJJRHHRTUIGTPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-11(2)7-12-10-5-8(6-14)3-4-9(10)13-11/h3-5,12-14H,6-7H2,1-2H3.
What are the key properties of (2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol?
(2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol has a molecular weight of 192.26 g/mol, XLogP of 1.79, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dimethyl-3,4-dihydro-1H-quinoxalin-6-yl)methanol is sourced from PubChem (CID 115096233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).